EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H16O6 |
| Net Charge | 0 |
| Average Mass | 328.320 |
| Monoisotopic Mass | 328.09469 |
| SMILES | COc1ccc(-c2c(C)oc3cc(O)cc(O)c3c2=O)cc1OC |
| InChI | InChI=1S/C18H16O6/c1-9-16(10-4-5-13(22-2)14(6-10)23-3)18(21)17-12(20)7-11(19)8-15(17)24-9/h4-8,19-20H,1-3H3 |
| InChIKey | OKMZAQXBYWZWCL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(3,4-dimethoxyphenyl)-5,7-dihydroxy-2-methyl-1-benzopyran-4-one (CHEBI:116889) is a 4'-methoxyisoflavones (CHEBI:133959) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28340 | LINCS |